Solanidine Solanidine
Structural formula
| Business number | 01RK |
|---|---|
| Molecular formula | C27H43NO |
| Molecular weight | 397.64 |
| label |
Solanine; hydrolyzed solanine; solanine; Solatubine |
Numbering system
CAS number:80-78-4
MDL number:None
EINECS number:201-309-5
RTECS number:WF0500000
BRN number:None
PubChem ID:None
Physical property data
1. Characteristics: white long needle-shaped crystals.
2. Density (g/mL,25/4℃): Unsure
3. Relative vapor density (g/mL,AIR=1): Unsure
4. Melting point (ºC): 218 ～219℃, sublimates and slightly decomposes when close to the melting point
5. Boiling point (ºC,Normal pressure):345℃ (decomposition)
6. Boiling point (ºC,5.2kPa): Unsure
7. Refractive index: Uncertain
8. Flashpoint (ºC): Unsure
9. Specific optical rotation (º):-29 （c =0.5, chloroform).
10. Autoignition point or ignition temperature (ºC): Unsure
11. Vapor pressure (kPa,25ºC): Unsure2、 Teratogenicity
Mouse: 1800 mg/kg/3D (Continuous)
Ecological data
None yet
Molecular structure data
1. Molar refractive index: 119.72
2. Molar volume (m3/mol）：361.3
3. isotonic specific volume (90.2K):936.2
4. Surface Tension (dyne/cm):45.0
5. Polarizability（10-24cm3):47.46
Compute chemical data
1. Reference value for hydrophobic parameter calculation (XlogP): 6.1
2. Number of hydrogen bond donors: 1
3. Number of hydrogen bond acceptors: 2
4. Number of rotatable chemical bonds: 0
5. Number of tautomers: none
6. Topological molecule polar surface area 23.5
7. Number of heavy atoms: 29
8. Surface charge: 0
9. Complexity: 715
10. Number of isotope atoms: 0
11. Determine the number of atomic stereocenters: 11
12. Uncertain number of atomic stereocenters: 0
13. Determine the number of chemical bond stereocenters: 0
14. Number of uncertain chemical bond stereocenters: 0
15. Number of covalent bond units: 1
Properties and stability
Double names are solanine and solanine. Needle-like crystals (chloroform–Methanol ), melting point218～ 219℃, sublimates and slightly decomposes when close to the melting point, derived from the Solanaceae plant potato (Solanum tuberosum L.) buds of peppers ( Capsicum frutescens L.) seeds, etc.
Storage method
This product should be sealed and stored in a cool place.
Synthesis method
It can be obtained by hydrolysis of solanine or artificially synthesized.
Purpose
For biochemical research.
Animal experiments have shown that it has a cardiotonic effect.
ascii-font-family: ‘Times New Roman’; mso-hansi-font-family: ‘Times New Roman’; mso-bidi-font-family: Arial”>（10-24cm3）：47.46
Compute chemical data
1. Reference value for hydrophobic parameter calculation (XlogP): 6.1
2. Number of hydrogen bond donors: 1
3. Number of hydrogen bond acceptors: 2
4. Number of rotatable chemical bonds: 0
5. Number of tautomers: none
6. Topological molecule polar surface area 23.5
7. Number of heavy atoms: 29
8. Surface charge: 0
9. Complexity: 715
10. Number of isotope atoms: 0
11. Determine the number of atomic stereocenters: 11
12. Uncertain number of atomic stereocenters: 0
13. Determine the number of chemical bond stereocenters: 0
14. Number of uncertain chemical bond stereocenters: 0
15. Number of covalent bond units: 1
Properties and stability
Double names are solanine and solanine. Needle-like crystals (chloroform–Methanol ), melting point218～ 219℃, sublimates and slightly decomposes when close to the melting point, derived from the Solanaceae plant potato (Solanum tuberosum L.) buds of peppers ( Capsicum frutescens L.) seeds, etc.
Storage method
This product should be sealed and stored in a cool place.
Synthesis method
It can be obtained by hydrolysis of solanine or artificially synthesized.
Purpose
For biochemical research.
Animal experiments have shown that it has a cardiotonic effect.